2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene

C21H40Lu — CID 57404171

IUPAC2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene
SMILESCC(C)=CC(C)C.CC(C)=CC(C)CCC(C)C=C(C)C.[Lu]
InChIInChI=1S/C14H26.C7H14.Lu/c1-11(2)9-13(5)7-8-14(6)10-12(3)4;1-6(2)5-7(3)4;/h9-10,13-14H,7-8H2,1-6H3;5-6H,1-4H3;
InChIKeyNMKCHEVKXQJGCJ-UHFFFAOYSA-N
MW467.52 g/mol
LogP7.58
Rot. Bonds6

About 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene

2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene (PubChem CID 57404171) has the molecular formula C21H40Lu and a molecular weight of 467.52 g/mol. Its IUPAC name is 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene.

Molecular Properties

Compound Name2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene
PubChem CID57404171
Molecular FormulaC21H40Lu
Molecular Weight467.52 g/mol
Exact Mass467.25
IUPAC Name2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene
SMILESCC(C)=CC(C)C.CC(C)=CC(C)CCC(C)C=C(C)C.[Lu]
InChIInChI=1S/C14H26.C7H14.Lu/c1-11(2)9-13(5)7-8-14(6)10-12(3)4;1-6(2)5-7(3)4;/h9-10,13-14H,7-8H2,1-6H3;5-6H,1-4H3;
InChIKeyNMKCHEVKXQJGCJ-UHFFFAOYSA-N
XLogP7.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.52
LogP ≤ 57.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(4R)-2,4-dimethylhex-2-ene
CID 142611901
2,4-dimethyldec-2-ene
CID 522542
2,4,6-trimethylhept-2-ene
CID 558039
(4R,6S)-2,4,6,7-tetramethyloct-2-ene
CID 59787440
6,8-dimethylnon-7-enyl acetate
CID 87610807
6,8-dimethylnon-7-en-1-ol;propanoic acid
CID 87611483
8-chloro-2,4,6-trimethylnon-2-ene
CID 86260523
4,6-dimethyl-2-methylidenehept-5-enal
CID 122553297
2,3,5-trimethylhexa-1,3-diene
CID 572950
(Z)-2,4-dimethylhex-3-ene
CID 5463169
2,4-dimethylpent-2-en-1-ol
CID 54511819
(4R)-2,4,5,5-tetramethylhex-2-ene
CID 172513214

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene?
The IUPAC name of 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene (CID 57404171) is 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene.
What is the SMILES notation for 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene?
The canonical SMILES for 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene is CC(C)=CC(C)C.CC(C)=CC(C)CCC(C)C=C(C)C.[Lu].
What is the InChIKey of 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene?
The InChIKey is NMKCHEVKXQJGCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26.C7H14.Lu/c1-11(2)9-13(5)7-8-14(6)10-12(3)4;1-6(2)5-7(3)4;/h9-10,13-14H,7-8H2,1-6H3;5-6H,1-4H3;.
What are the key properties of 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene?
2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene has a molecular weight of 467.52 g/mol, XLogP of 7.58, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylpent-2-ene;lutetium;2,4,7,9-tetramethyldeca-2,8-diene is sourced from PubChem (CID 57404171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).